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2-HYDROXY-2-TRIFLUOROMETHYL-4-HEXENOIC ACID, METHYL ESTER
SpectraBase Compound ID 7rAb85aNKBj
InChI InChI=1S/C8H11F3O3/c1-3-4-5-7(13,6(12)14-2)8(9,10)11/h3-4,13H,5H2,1-2H3/b4-3+
InChIKey HPKLQYVCLSSYMS-ONEGZZNKSA-N
Mol Weight 212.17 g/mol
Molecular Formula C8H11F3O3
Exact Mass 212.066029 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 86qG4djc7gG
Name 2-HYDROXY-2-TRIFLUOROMETHYL-4-HEXENOIC ACID, METHYL ESTER
Comments SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H11F3O3
InChI InChI=1S/C8H11F3O3/c1-3-4-5-7(13,6(12)14-2)8(9,10)11/h3-4,13H,5H2,1-2H3/b4-3+
InChIKey HPKLQYVCLSSYMS-ONEGZZNKSA-N
Instrument Name SEE COMMENT
Literature Reference A.S.GOLUBEV, A.F.KOLOMIETS, A.V.FOKIN (1988) Izv.Akad.Nauk SSSR(Russ. Lang.):N1, 127-132.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl